N-(2-bromophenyl)-N'-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-2-methyl-propanediamide

Systemtic Name: N-(2-bromophenyl)-N'-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-2-methyl-propanediamide Openeye Name: N-(2-bromophenyl)-N'-[(3-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-2-methyl-propanediamide CAS Name: N-(2-bromophenyl)-N'-[(3-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-2-methylpropanediamide IUPAC Name: N-(2-bromophenyl)-N'-[(3-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-2-methylpropanediamide Traditional Name: N-(2-bromophenyl)-N'-[(3-methoxy-4-propargyloxy-benzylidene)amino]-2-methyl-malonamide Formula: C21H20BrN3O4 MolecularWeight: 458.3052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1Br)C(=O)NN=CC2=CC(=C(C=C2)OCC#C)OC

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1Br)C(=O)NN=CC2=CC(=C(C=C2)OCC#C)OC

InChI

InChI=1S/C21H20BrN3O4/c1-4-11-29-18-10-9-15(12-19(18)28-3)13-23-25-21(27)14(2)20(26)24-17-8-6-5-7-16(17)22/h1,5-10,12-14H,11H2,2-3H3,(H,24,26)(H,25,27)